1-{4-[(4-ethylbenzene-1-sulfonyl)amino]phenyl}-N-(propan-2-yl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
1-{4-[(4-ethylbenzene-1-sulfonyl)amino]phenyl}-N-(propan-2-yl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
1-{4-[(4-ethylbenzene-1-sulfonyl)amino]phenyl}-N-(propan-2-yl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L164-0118 |
| Compound Name: | 1-{4-[(4-ethylbenzene-1-sulfonyl)amino]phenyl}-N-(propan-2-yl)cyclopropane-1-carboxamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 500.54 |
| Molecular Formula: | C21 H26 N2 O3 S |
| Salt: | CF3COOH |
| Smiles: | CCc1ccc(cc1)S(Nc1ccc(cc1)C1(CC1)C(NC(C)C)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0006 |
| logD: | 3.9884 |
| logSw: | -3.9963 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.799 |
| InChI Key: | LRIIPLOFDGVLMV-UHFFFAOYSA-N |